5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide

C17H12Cl2N2O2 — CID 2885301

IUPAC5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
SMILESO=C(NCc1cccnc1)c1ccc(-c2cc(Cl)ccc2Cl)o1
InChIInChI=1S/C17H12Cl2N2O2/c18-12-3-4-14(19)13(8-12)15-5-6-16(23-15)17(22)21-10-11-2-1-7-20-9-11/h1-9H,10H2,(H,21,22)
InChIKeyGBYSKDLNUGOFNK-UHFFFAOYSA-N
MW347.20 g/mol
LogP4.58
Rot. Bonds4

About 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide

5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide (PubChem CID 2885301) has the molecular formula C17H12Cl2N2O2 and a molecular weight of 347.20 g/mol. Its IUPAC name is 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
PubChem CID2885301
Molecular FormulaC17H12Cl2N2O2
Molecular Weight347.20 g/mol
Exact Mass346.03
IUPAC Name5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
SMILESO=C(NCc1cccnc1)c1ccc(-c2cc(Cl)ccc2Cl)o1
InChIInChI=1S/C17H12Cl2N2O2/c18-12-3-4-14(19)13(8-12)15-5-6-16(23-15)17(22)21-10-11-2-1-7-20-9-11/h1-9H,10H2,(H,21,22)
InChIKeyGBYSKDLNUGOFNK-UHFFFAOYSA-N
XLogP4.58
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.20
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
The IUPAC name of 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide (CID 2885301) is 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
The canonical SMILES for 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide is O=C(NCc1cccnc1)c1ccc(-c2cc(Cl)ccc2Cl)o1.
What is the InChIKey of 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
The InChIKey is GBYSKDLNUGOFNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O2/c18-12-3-4-14(19)13(8-12)15-5-6-16(23-15)17(22)21-10-11-2-1-7-20-9-11/h1-9H,10H2,(H,21,22).
What are the key properties of 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide?
5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide has a molecular weight of 347.20 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dichlorophenyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 2885301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).